N-(2-methylphenyl)-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Chemical Structure Depiction of
N-(2-methylphenyl)-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
N-(2-methylphenyl)-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Compound characteristics
| Compound ID: | F943-0088 |
| Compound Name: | N-(2-methylphenyl)-2-oxo-3-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide |
| Molecular Weight: | 431.53 |
| Molecular Formula: | C20 H21 N3 O4 S2 |
| Smiles: | Cc1ccccc1NS(c1ccc2c(c1)SC(N2CC(N1CCCC1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0355 |
| logD: | 3.0316 |
| logSw: | -3.5179 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.521 |
| InChI Key: | YFLZVBCNKHYDGK-UHFFFAOYSA-N |